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Updated: Feb 12, 2026

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
Published on: September 17, 2021
Molecular dynamics simulations of inverse patchy colloids
Silvano Ferrari1, Gerhard Kahl1, Emanuela Bianchi2,3
1Institut für Theoretische Physik, TU Wien and Center for Computational Materials Science (CMS), Wiedner Hauptstraße 8-10, A-1040, Wien, Austria.
Abstract:
Inverse patchy colloids are patchy particles with differently charged surface regions. In this paper we focus on inverse patchy colloids with two different polar patches and an oppositely charged equatorial belt, and we describe a model and a reliable and efficient numerical algorithm that can be applied to investigate the properties of these particles in molecular dynamics simulations.
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